Vitas-M small molecule compound
2-methoxyethyl 4-(3-bromo-4-methoxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK067995
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)Br)OC)C(=O)CC(C2)c1ccc(cc1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H27BrClNO5 MW 560.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27BrClNO5/c1-15-24(27(32)35-11-10-33-2)25(17-6-9-23(34-3)20(28)12-17)26-21(30-15)13-18(14-22(26)31)16-4-7-19(29)8-5-16/h4-9,12,18,25,30H,10-11,13-14H2,1-3H3InChIKey
YDQPDIAAXXLVFS-UHFFFAOYSA-NSynonyms
5715-61-72methoxyethyl4(3bromo4methoxyphenyl)7(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(3bromo4methoxyphenyl)7(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
5715617
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=C(C=C4)OC)Br)C(=O)OCCOC
COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)Br)OC)C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC27H27BrClNO5c11524(27(32)351110332)25(176923(343)20(28)1217)2621(3015)1318(1422(26)31)164719(29)8516h4912182530H10111314H213H3
MFCD02632933
STK067995
ZINC000002772157
ZINC000002772160
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